ChemSpider 2D Image | 4-[(3-Methylphenyl)sulfanyl]piperidine | C12H17NS

4-[(3-Methylphenyl)sulfanyl]piperidine

  • Molecular FormulaC12H17NS
  • Average mass207.335 Da
  • Monoisotopic mass207.108170 Da
  • ChemSpider ID21491869

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-[(3-Methylphenyl)sulfanyl]piperidin [German] [ACD/IUPAC Name]
4-[(3-Methylphenyl)sulfanyl]piperidine [ACD/IUPAC Name]
4-[(3-Méthylphényl)sulfanyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 4-[(3-methylphenyl)thio]- [ACD/Index Name]
4-(3-methylphenyl)sulfanylpiperidine
4-(M-tolylthio)piperidine hydrochloride
4-[(3-methylphenyl)thio]piperidine
882863-88-9 [RN]
882973-59-3 [RN]
MFCD09055244 [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 323.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.6±3.0 kJ/mol
    Flash Point: 149.5±25.9 °C
    Index of Refraction: 1.583
    Molar Refractivity: 64.1±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.15
    ACD/LogD (pH 5.5): 0.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.15
    ACD/LogD (pH 7.4): 0.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.73
    Polar Surface Area: 37 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 43.0±5.0 dyne/cm
    Molar Volume: 191.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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